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Machine learning applications cover a wide range of predictive tasks in which tabular datasets play a significant role. However, although they often address similar problems, tabular datasets are typically treated as standalone tasks. The…

Machine Learning · Computer Science 2023-06-21 Katarzyna Woźnica , Piotr Wilczyński , Przemysław Biecek

Knowledge Graphs have been one of the fundamental methods for integrating heterogeneous data sources. Integrating heterogeneous data sources is crucial, especially in the biomedical domain, where central data-driven tasks such as drug…

Machine Learning · Computer Science 2020-12-22 Islam Akef Ebeid , Majdi Hassan , Tingyi Wanyan , Jack Roper , Abhik Seal , Ying Ding

In most safety-critical domains the need for traceability is prescribed by certifying bodies. Trace links are generally created among requirements, design, source code, test cases and other artifacts, however, creating such links manually…

Software Engineering · Computer Science 2018-04-10 Jin Guo , Jinghui Cheng , Jane Cleland-Huang

Scaffold based drug discovery (SBDD) is a technique for drug discovery which pins chemical scaffolds as the framework of design. Scaffolds, or molecular frameworks, organize the design of compounds into local neighborhoods. We formalize…

Quantitative Methods · Quantitative Biology 2021-09-13 Austin Clyde , Ashka Shah , Max Zvyagin , Arvind Ramanathan , Rick Stevens

Word Sense Disambiguation (WSD) aims to automatically identify the exact meaning of one word according to its context. Existing supervised models struggle to make correct predictions on rare word senses due to limited training data and can…

Computation and Language · Computer Science 2021-10-28 Wenlin Yao , Xiaoman Pan , Lifeng Jin , Jianshu Chen , Dian Yu , Dong Yu

Motivation: The importance of clinical data in understanding the pathophysiology of complex disorders has prompted the launch of multiple initiatives designed to generate patient-level data from various modalities. While these studies can…

New Intent Discovery (NID) aims to recognize both new and known intents from unlabeled data with the aid of limited labeled data containing only known intents. Without considering structure relationships between samples, previous methods…

Computation and Language · Computer Science 2023-10-25 Wenkai Shi , Wenbin An , Feng Tian , Qinghua Zheng , QianYing Wang , Ping Chen

Rule mining on knowledge graphs allows for explainable link prediction. Contrarily, embedding-based methods for link prediction are well known for their generalization capabilities, but their predictions are not interpretable. Several…

Artificial Intelligence · Computer Science 2024-06-17 N'Dah Jean Kouagou , Arif Yilmaz , Michel Dumontier , Axel-Cyrille Ngonga Ngomo

Drug repurposing has historically been an economically infeasible process for identifying novel uses for abandoned drugs. Modern machine learning has enabled the identification of complex biochemical intricacies in candidate drugs; however,…

Machine Learning · Computer Science 2025-09-16 Luke Delzer , Robert Kroleski , Ali K. AlShami , Jugal Kalita

Carrying out research tasks is only inadequately supported, if not hindered, by current web search engines. This paper therefore proposes functional extensions of WebMap, a semantically induced overlay linking structure on the web to…

Information Retrieval · Computer Science 2025-04-15 Shiraj Pokharel , Georg P. Roßrucker , Mario M. Kubek

Introduction: Semantic search, which retrieves documents based on conceptual similarity rather than keyword matching, offers substantial advantages for retrieval of clinical information. However, deploying semantic search across entire…

Drug repurposing is an effective strategy to identify new uses for existing drugs, providing the quickest possible transition from bench to bedside. Existing methods for drug repurposing that mainly focus on pre-clinical information may…

Applications · Statistics 2021-04-14 Ruoqi Liu , Lai Wei , Ping Zhang

In this paper, we introduce the semantic knowledge of medical images from their diagnostic reports to provide an inspirational network training and an interpretable prediction mechanism with our proposed novel multimodal neural network,…

Computer Vision and Pattern Recognition · Computer Science 2017-08-11 Zizhao Zhang , Pingjun Chen , Manish Sapkota , Lin Yang

Sequence labeling is a widely used method for named entity recognition and information extraction from unstructured natural language data. In clinical domain one major application of sequence labeling involves extraction of medical entities…

Computation and Language · Computer Science 2016-08-03 Abhyuday Jagannatha , Hong Yu

For large libraries of small molecules, exhaustive combinatorial chemical screens become infeasible to perform when considering a range of disease models, assay conditions, and dose ranges. Deep learning models have achieved state of the…

The Chem2Bio2RDF portal is a Linked Open Data (LOD) portal for systems chemical biology aiming for facilitating drug discovery. It converts around 25 different datasets on genes, compounds, drugs, pathways, side effects, diseases, and…

Information Retrieval · Computer Science 2010-12-22 Bin Chen , David J Wild , Qian Zhu , Ying Ding , Xiao Dong , Madhuvanthi Sankaranarayanan , Huijun Wang , Yuyin Sun

Off-the-shelf biomedical embeddings obtained from the recently released various pre-trained language models (such as BERT, XLNET) have demonstrated state-of-the-art results (in terms of accuracy) for the various natural language…

Computation and Language · Computer Science 2020-12-22 Ishani Mondal

Predicting interactions between small molecules and proteins is a crucial ingredient of the drug discovery process. In particular, accurate predictive models are increasingly used to preselect potential lead compounds from large molecule…

Quantitative Methods · Quantitative Biology 2007-09-26 Laurent Jacob , Jean-Philippe Vert

Modern disease classification often overlooks molecular commonalities hidden beneath divergent clinical presentations. This study introduces a transcriptomics-driven framework for discovering disease relationships by analyzing over 1300…

Genomics · Quantitative Biology 2025-08-08 Ke Chen , Haohan Wang

The most interesting words in scientific texts will often be novel or rare. This presents a challenge for scientific word embedding models to determine quality embedding vectors for useful terms that are infrequent or newly emerging. We…

Computation and Language · Computer Science 2022-10-28 Jason Hoelscher-Obermaier , Edward Stevinson , Valentin Stauber , Ivaylo Zhelev , Victor Botev , Ronin Wu , Jeremy Minton
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